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BDBM50118701 6-(4-Carboxy-imidazol-1-ylmethyl)-decahydro-isoquinoline-3-carboxylic acid; hydrochloride::CHEMBL542242

SMILES: OC(=O)[C@@H]1C[C@H]2C[C@@H](Cn3cnc(c3)C(O)=O)CC[C@H]2CN1

InChI Key: InChIKey=CQEYRNLQNUBIGU-YFKTTZPYSA-N

Data: 6 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50118701   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
GRIA2


(Homo sapiens (Human))
BDBM50118701
PNG
(6-(4-Carboxy-imidazol-1-ylmethyl)-decahydro-isoqui...)
Show SMILES OC(=O)[C@@H]1C[C@H]2C[C@@H](Cn3cnc(c3)C(O)=O)CC[C@H]2CN1
Show InChI InChI=1S/C15H21N3O4/c19-14(20)12-4-11-3-9(1-2-10(11)5-16-12)6-18-7-13(15(21)22)17-8-18/h7-12,16H,1-6H2,(H,19,20)(H,21,22)/t9-,10-,11+,12-/m0/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
PubMed
1.17E+5n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Ability to displace binding of [3H]AMPA to recombinant human Ionotropic glutamate receptor AMPA 2


J Med Chem 45: 4383-6 (2002)


BindingDB Entry DOI: 10.7270/Q2XP75N4
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50118701
PNG
(6-(4-Carboxy-imidazol-1-ylmethyl)-decahydro-isoqui...)
Show SMILES OC(=O)[C@@H]1C[C@H]2C[C@@H](Cn3cnc(c3)C(O)=O)CC[C@H]2CN1
Show InChI InChI=1S/C15H21N3O4/c19-14(20)12-4-11-3-9(1-2-10(11)5-16-12)6-18-7-13(15(21)22)17-8-18/h7-12,16H,1-6H2,(H,19,20)(H,21,22)/t9-,10-,11+,12-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
PubMed
1.34E+5n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Ability to displace binding of [3H]AMPA to recombinant human Ionotropic glutamate receptor AMPA 1


J Med Chem 45: 4383-6 (2002)


BindingDB Entry DOI: 10.7270/Q2XP75N4
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 2


(Homo sapiens (Human))
BDBM50118701
PNG
(6-(4-Carboxy-imidazol-1-ylmethyl)-decahydro-isoqui...)
Show SMILES OC(=O)[C@@H]1C[C@H]2C[C@@H](Cn3cnc(c3)C(O)=O)CC[C@H]2CN1
Show InChI InChI=1S/C15H21N3O4/c19-14(20)12-4-11-3-9(1-2-10(11)5-16-12)6-18-7-13(15(21)22)17-8-18/h7-12,16H,1-6H2,(H,19,20)(H,21,22)/t9-,10-,11+,12-/m0/s1
PDB

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2.36E+5n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Ability to displace binding of [3H]KA to recombinant human KA receptor Ionotropic glutamate receptor ionotropic kainate 2 expressed in EK 293 cell me...


J Med Chem 45: 4383-6 (2002)


BindingDB Entry DOI: 10.7270/Q2XP75N4
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic AMPA


(Homo sapiens (Human))
BDBM50118701
PNG
(6-(4-Carboxy-imidazol-1-ylmethyl)-decahydro-isoqui...)
Show SMILES OC(=O)[C@@H]1C[C@H]2C[C@@H](Cn3cnc(c3)C(O)=O)CC[C@H]2CN1
Show InChI InChI=1S/C15H21N3O4/c19-14(20)12-4-11-3-9(1-2-10(11)5-16-12)6-18-7-13(15(21)22)17-8-18/h7-12,16H,1-6H2,(H,19,20)(H,21,22)/t9-,10-,11+,12-/m0/s1
PDB
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2.47E+5n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Ability to displace binding of [3H]AMPA to recombinant human Ionotropic glutamate receptor AMPA 3


J Med Chem 45: 4383-6 (2002)


BindingDB Entry DOI: 10.7270/Q2XP75N4
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic AMPA


(Homo sapiens (Human))
BDBM50118701
PNG
(6-(4-Carboxy-imidazol-1-ylmethyl)-decahydro-isoqui...)
Show SMILES OC(=O)[C@@H]1C[C@H]2C[C@@H](Cn3cnc(c3)C(O)=O)CC[C@H]2CN1
Show InChI InChI=1S/C15H21N3O4/c19-14(20)12-4-11-3-9(1-2-10(11)5-16-12)6-18-7-13(15(21)22)17-8-18/h7-12,16H,1-6H2,(H,19,20)(H,21,22)/t9-,10-,11+,12-/m0/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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PC sid
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2.62E+5n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Ability to displace binding of [3H]AMPA to recombinant human Ionotropic glutamate receptor AMPA 4


J Med Chem 45: 4383-6 (2002)


BindingDB Entry DOI: 10.7270/Q2XP75N4
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 2


(Homo sapiens (Human))
BDBM50118701
PNG
(6-(4-Carboxy-imidazol-1-ylmethyl)-decahydro-isoqui...)
Show SMILES OC(=O)[C@@H]1C[C@H]2C[C@@H](Cn3cnc(c3)C(O)=O)CC[C@H]2CN1
Show InChI InChI=1S/C15H21N3O4/c19-14(20)12-4-11-3-9(1-2-10(11)5-16-12)6-18-7-13(15(21)22)17-8-18/h7-12,16H,1-6H2,(H,19,20)(H,21,22)/t9-,10-,11+,12-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
>1.00E+6n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Ability to displace binding of [3H]AMPA to recombinant human AMPA receptor Ionotropic glutamate receptor ionotropic kainate 2


J Med Chem 45: 4383-6 (2002)


BindingDB Entry DOI: 10.7270/Q2XP75N4
More data for this
Ligand-Target Pair